Pararealgar Kutoglu A Zeitschrift fur Anorganische und Allgemeine Chemie 419 (1976) 176-184 Darstellung und kristallstruktur einer neuen isomeren form von As4S4 Locality: synthetic _database_code_amcsd 0015782 CELL PARAMETERS: 11.1930 9.9940 7.1530 90.000 92.800 90.000 SPACE GROUP: P2_1/n X-RAY WAVELENGTH: 1.541838 Cell Volume: 799.200 Density (g/cm3): 3.556 MAX. ABS. INTENSITY / VOLUME**2: 13.75380963 RIR: 1.259 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 11.88 18.44 7.4509 1 1 0 4 14.38 33.63 6.1582 -1 0 1 2 15.04 31.29 5.8910 1 0 1 2 16.91 45.19 5.2428 -1 1 1 4 17.47 54.16 5.0749 1 1 1 4 17.75 3.71 4.9970 0 2 0 2 18.18 35.77 4.8786 2 1 0 4 19.46 100.00 4.5620 1 2 0 4 21.62 15.33 4.1113 -2 1 1 4 21.70 1.68 4.0948 0 2 1 4 22.92 5.86 3.8803 -1 2 1 4 23.34 1.87 3.8107 1 2 1 4 23.89 3.82 3.7254 2 2 0 4 25.51 13.12 3.4917 3 1 0 4 26.50 7.23 3.3638 0 1 2 4 26.62 42.10 3.3483 -2 2 1 4 27.33 8.51 3.2628 -1 1 2 4 27.36 3.00 3.2601 2 2 1 4 27.53 9.06 3.2398 3 0 1 2 27.92 2.24 3.1953 -3 1 1 4 27.95 52.30 3.1926 1 3 0 4 28.05 1.49 3.1810 1 1 2 4 28.97 54.95 3.0819 3 1 1 4 29.00 46.93 3.0791 -2 0 2 2 29.59 4.32 3.0192 0 3 1 4 29.91 44.97 2.9873 3 2 0 4 30.35 49.33 2.9455 2 0 2 2 30.38 51.87 2.9426 -2 1 2 4 30.51 9.34 2.9301 -1 3 1 4 30.77 16.76 2.9060 0 2 2 4 30.84 2.07 2.8998 1 3 1 4 31.50 10.67 2.8402 -1 2 2 4 31.67 21.16 2.8253 2 1 2 4 32.02 11.28 2.7953 -3 2 1 4 32.13 14.22 2.7857 1 2 2 4 32.95 7.63 2.7185 3 2 1 4 33.29 6.53 2.6916 4 1 0 4 33.44 21.79 2.6797 -2 3 1 4 34.04 15.57 2.6339 2 3 1 4 35.94 23.20 2.4985 0 4 0 2 36.17 8.18 2.4836 3 3 0 4 36.21 11.91 2.4806 4 1 1 4 36.81 4.05 2.4417 3 1 2 4 36.89 2.59 2.4363 0 3 2 4 37.52 7.36 2.3971 -1 3 2 4 37.97 1.28 2.3700 -3 3 1 4 38.06 14.52 2.3641 1 3 2 4 38.25 7.85 2.3528 -1 0 3 2 38.52 30.12 2.3371 -3 2 2 4 38.77 6.21 2.3226 3 3 1 4 38.87 1.87 2.3166 0 1 3 4 39.05 6.74 2.3064 1 0 3 2 39.51 4.10 2.2810 2 4 0 4 39.54 19.86 2.2789 4 2 1 4 39.98 1.68 2.2553 -4 0 2 2 40.12 2.46 2.2473 1 1 3 4 41.31 6.44 2.1856 -2 4 1 4 41.38 2.43 2.1820 5 1 0 4 41.48 4.35 2.1770 -2 1 3 4 42.47 3.58 2.1286 -1 2 3 4 42.75 4.05 2.1152 -5 1 1 4 43.02 13.83 2.1027 4 1 2 4 43.61 2.44 2.0752 3 4 0 4 43.68 8.34 2.0725 -4 3 1 4 44.05 2.68 2.0557 -4 2 2 4 44.12 2.16 2.0527 -3 0 3 2 44.24 11.06 2.0474 0 4 2 4 44.48 3.33 2.0369 -2 2 3 4 45.09 1.90 2.0108 -3 1 3 4 45.14 1.03 2.0088 3 3 2 4 45.16 15.05 2.0076 -3 4 1 4 45.68 1.22 1.9860 -5 2 1 4 45.87 1.17 1.9785 3 4 1 4 45.94 2.92 1.9756 4 2 2 4 46.23 2.64 1.9637 3 0 3 2 46.83 6.49 1.9401 -2 4 2 4 46.84 1.34 1.9397 5 2 1 4 47.22 2.89 1.9249 0 5 1 4 47.73 5.23 1.9054 2 4 2 4 47.80 10.03 1.9029 -5 1 2 4 47.91 3.00 1.8988 -3 2 3 4 48.07 3.59 1.8928 1 5 1 4 48.90 6.08 1.8627 4 4 0 4 49.07 1.59 1.8565 5 3 0 4 49.90 2.00 1.8276 3 2 3 4 49.92 7.80 1.8267 -4 1 3 4 50.01 13.31 1.8238 5 1 2 4 50.24 1.27 1.8160 -3 4 2 4 50.27 1.70 1.8149 -5 3 1 4 50.34 4.66 1.8127 2 5 1 4 50.47 7.63 1.8084 2 3 3 4 50.51 1.57 1.8069 4 3 2 4 50.86 6.01 1.7952 -6 1 1 4 51.07 4.72 1.7883 4 4 1 4 51.14 11.71 1.7861 0 0 4 2 51.35 1.29 1.7794 5 3 1 4 52.14 5.12 1.7542 6 1 1 4 52.41 5.04 1.7459 6 2 0 4 52.46 1.20 1.7443 0 5 2 4 52.55 15.74 1.7416 -4 2 3 4 52.63 3.15 1.7390 5 2 2 4 53.12 5.79 1.7242 1 1 4 4 53.35 2.73 1.7172 1 5 2 4 53.45 2.33 1.7141 -6 2 1 4 53.50 11.49 1.7129 -1 4 3 4 53.90 6.66 1.7011 3 5 1 4 54.69 1.84 1.6783 6 2 1 4 54.75 9.09 1.6765 -2 5 2 4 54.79 1.40 1.6754 -5 3 2 4 54.82 5.04 1.6746 -1 2 4 4 54.94 2.52 1.6713 -5 0 3 2 55.14 8.96 1.6657 0 6 0 2 55.54 10.40 1.6546 2 1 4 4 55.56 3.38 1.6539 2 5 2 4 55.80 2.20 1.6475 1 6 0 4 56.41 1.73 1.6311 2 4 3 4 56.61 1.98 1.6258 4 5 0 4 56.81 3.84 1.6207 5 3 2 4 57.59 7.86 1.6005 -6 3 1 4 57.80 2.34 1.5951 -4 5 1 4 57.99 1.18 1.5905 2 2 4 4 58.21 1.03 1.5850 -5 2 3 4 58.53 4.64 1.5771 7 1 0 4 58.77 7.12 1.5712 6 3 1 4 58.89 4.83 1.5681 -1 3 4 4 59.09 4.21 1.5634 4 3 3 4 59.40 1.16 1.5559 -7 1 1 4 60.75 1.30 1.5246 7 1 1 4 60.92 2.99 1.5207 3 6 0 4 61.53 3.04 1.5072 3 2 4 4 61.85 2.21 1.5002 -1 6 2 4 61.92 1.58 1.4985 2 3 4 4 62.15 1.21 1.4937 6 4 0 4 62.22 2.86 1.4920 1 6 2 4 62.27 1.76 1.4910 -4 4 3 4 62.38 1.65 1.4886 -2 5 3 4 62.72 1.66 1.4814 3 6 1 4 63.30 1.97 1.4692 -7 1 2 4 63.34 2.23 1.4684 -5 5 1 4 63.50 1.26 1.4650 -2 6 2 4 63.54 2.03 1.4642 4 5 2 4 64.24 1.45 1.4499 2 6 2 4 66.36 1.27 1.4087 1 0 5 2 66.95 1.90 1.3977 -6 4 2 4 67.41 2.52 1.3892 -5 4 3 4 68.42 1.52 1.3712 -8 1 1 4 69.11 1.32 1.3592 6 4 2 4 69.63 1.79 1.3503 1 6 3 4 70.60 2.18 1.3340 -8 2 1 4 70.65 1.30 1.3332 3 7 0 4 73.73 2.73 1.2851 2 5 4 4 75.32 1.04 1.2618 5 3 4 4 78.02 1.97 1.2247 -9 1 1 4 78.52 1.60 1.2182 0 6 4 4 80.58 2.01 1.1921 -3 4 5 4 83.71 1.43 1.1554 -8 3 3 4 84.23 1.27 1.1495 -5 7 2 4 84.30 1.80 1.1488 8 2 3 4 85.90 1.66 1.1314 5 7 2 4 86.73 1.05 1.1228 4 8 1 4 89.31 1.63 1.0968 -6 3 5 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.